ChemSpider 2D Image | (6R)-3,6-Anhydro-1,2,4-trideoxy-1-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-[(phosphonooxy)methyl]-D-erythro-hexitol | C12H19N2O8P

(6R)-3,6-Anhydro-1,2,4-trideoxy-1-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-[(phosphonooxy)methyl]-D-erythro-hexitol

  • Molecular FormulaC12H19N2O8P
  • Average mass350.262 Da
  • Monoisotopic mass350.087891 Da
  • ChemSpider ID34222889
  • defined stereocentres - 3 of 3 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(6R)-3,6-Anhydro-1,2,4-trideoxy-1-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-[(phosphonooxy)methyl]-D-erythro-hexitol [ACD/IUPAC Name]
(6R)-3,6-Anhydro-1,2,4-tridesoxy-1-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-[(phosphonooxy)methyl]-D-erythro-hexitol [German] [ACD/IUPAC Name]
(6R)-3,6-Anhydro-1,2,4-tridésoxy-1-(5-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-[(phosphonooxy)méthyl]-D-érythro-hexitol [French] [ACD/IUPAC Name]
D-ribo-Heptitol, 3,6-anhydro-1,2,4-trideoxy-1-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)-, 7-(dihydrogen phosphate) [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.555
Molar Refractivity: 75.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -1.83
ACD/LogD (pH 5.5): -5.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 61.5±3.0 dyne/cm
Molar Volume: 234.8±3.0 cm3

Click to predict properties on the Chemicalize site






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